smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)COc1ccc([C@H](C)NC(=O)C2CCN(C)CC2)cc1	ZINC000159653682	186133166	/nfs/dbraw/zinc/13/31/66/186133166.db2.gz	VIHXAIGSHDOWHG-HNNXBMFYSA-N	0	3	318.461	3.240	10	70		DGIEHN
Cc1ccc(C(=O)CCN2CC[C@@H](CNc3ccccn3)C2)cc1	ZINC000159765231	197362857	/nfs/dbraw/zinc/36/28/57/197362857.db2.gz	UKIHNUXJYNSYSD-KRWDZBQOSA-N	0	3	323.440	3.397	10	70		DGIEHN
CCN(CCOc1cccc(OC)c1)CCc1nccs1	ZINC000159441518	197353855	/nfs/dbraw/zinc/35/38/55/197353855.db2.gz	MHOTVCQWWFGQDX-UHFFFAOYSA-N	0	3	306.431	3.095	10	70		DGIEHN
COCCCCN1C[C@@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000161072539	432757778	/nfs/dbraw/zinc/75/77/78/432757778.db2.gz	SVFUIVRONYPDLY-LSDHHAIUSA-N	0	3	317.351	3.240	10	70		DGIEHN
COc1ccccc1[C@@H](C)NCCCc1nc(C(C)C)no1	ZINC000160788234	432741012	/nfs/dbraw/zinc/74/10/12/432741012.db2.gz	KIVLQMMFQHJSFB-CYBMUJFWSA-N	0	3	303.406	3.485	10	70		DGIEHN
Cc1nnc(NC[C@@]2(C)CCCN2Cc2ccccc2)s1	ZINC000160801538	432742961	/nfs/dbraw/zinc/74/29/61/432742961.db2.gz	OHDKAYCTDXFJQI-MRXNPFEDSA-N	0	3	302.447	3.313	10	70		DGIEHN
CCN(CCC(=O)N(C)c1ccccc1)CCc1nccs1	ZINC000159442260	546053169	/nfs/dbraw/zinc/05/31/69/546053169.db2.gz	CKIVROOJTBKABY-UHFFFAOYSA-N	0	3	317.458	3.061	10	70		DGIEHN
Brc1ccc(CN[C@H]2CCCOC2)c2ncccc12	ZINC000160326679	546059677	/nfs/dbraw/zinc/05/96/77/546059677.db2.gz	IXOUXOALONRJMV-LBPRGKRZSA-N	0	3	321.218	3.266	10	70		DGIEHN
C[C@@H]1OCC[C@H]1NCc1ccc(Br)c2cccnc12	ZINC000160338913	546060098	/nfs/dbraw/zinc/06/00/98/546060098.db2.gz	ZJMJEWVGOVFZKC-IINYFYTJSA-N	0	3	321.218	3.264	10	70		DGIEHN
CC[C@@](C)(O)CN(C)Cc1cc(OC)c(OC)cc1SC	ZINC000161225442	529508137	/nfs/dbraw/zinc/50/81/37/529508137.db2.gz	FIKXJZVIMAYVCF-MRXNPFEDSA-N	0	3	313.463	3.019	10	70		DGIEHN
CCOc1ccc(Cl)cc1[C@H](C)NCCCN1CCCC1=O	ZINC000159503482	197358348	/nfs/dbraw/zinc/35/83/48/197358348.db2.gz	VRODINMECLDELA-ZDUSSCGKSA-N	0	3	324.852	3.402	10	70		DGIEHN
Cc1cnn([C@@H]2CCCN(CCC(=O)c3ccc(C)cc3)C2)c1	ZINC000159467248	197356103	/nfs/dbraw/zinc/35/61/03/197356103.db2.gz	IVOKHCZRIWFMIO-GOSISDBHSA-N	0	3	311.429	3.410	10	70		DGIEHN
CN(C)[C@@H]1CCN(C(=O)Cc2cc3c(ccc4ccccc34)o2)C1	ZINC000160514251	432724214	/nfs/dbraw/zinc/72/42/14/432724214.db2.gz	UOMFLSRDZBYWHN-OAHLLOKOSA-N	0	3	322.408	3.291	10	70		DGIEHN
CCC[C@H](C(=O)N(C)Cc1ccccc1C(F)(F)F)N(C)C	ZINC000161413466	432778673	/nfs/dbraw/zinc/77/86/73/432778673.db2.gz	OSCGZPDXJKTQID-CQSZACIVSA-N	0	3	316.367	3.394	10	70		DGIEHN
C[C@@H]1CCCCN1CCNC(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F	ZINC000160577356	432728241	/nfs/dbraw/zinc/72/82/41/432728241.db2.gz	UFVNXKRVZYCVEK-XNRPHZJLSA-N	0	3	322.399	3.059	10	70		DGIEHN
Cc1cnn([C@H]2CCCN(CCC(=O)c3ccc(C)cc3)C2)c1	ZINC000159467097	197356327	/nfs/dbraw/zinc/35/63/27/197356327.db2.gz	IVOKHCZRIWFMIO-SFHVURJKSA-N	0	3	311.429	3.410	10	70		DGIEHN
CO[C@]1(CN[C@@H]2CCCc3sc(Cl)cc32)CCOC1	ZINC000160099100	432706188	/nfs/dbraw/zinc/70/61/88/432706188.db2.gz	YBYZDHPMKKOBQW-RISCZKNCSA-N	0	3	301.839	3.174	10	70		DGIEHN
C[C@@]1(C(=O)NC2CCN(C3CC3)CC2)CCCc2ccccc21	ZINC000159378924	432682007	/nfs/dbraw/zinc/68/20/07/432682007.db2.gz	AEGNOGLVBGIUSU-HXUWFJFHSA-N	0	3	312.457	3.024	10	70		DGIEHN
C[C@@H](c1ccncc1)N(C)CCN(C)Cc1ccc(F)cc1	ZINC000161186980	432765704	/nfs/dbraw/zinc/76/57/04/432765704.db2.gz	YNLYWXJFZIZXAB-HNNXBMFYSA-N	0	3	301.409	3.346	10	70		DGIEHN
CCn1cnnc1[C@@H]1CCCN([C@@H](C)c2ccccc2F)C1	ZINC000161267225	432769343	/nfs/dbraw/zinc/76/93/43/432769343.db2.gz	NXTLWHKIJCLXDW-UONOGXRCSA-N	0	3	302.397	3.378	10	70		DGIEHN
CCn1cnnc1[C@@H]1CCCN(Cc2cccc(Cl)c2)C1	ZINC000161308631	432770975	/nfs/dbraw/zinc/77/09/75/432770975.db2.gz	JJIKKSVVRVQXMK-CQSZACIVSA-N	0	3	304.825	3.331	10	70		DGIEHN
CCC[C@@H](C(=O)N1CCC(Oc2ccc(C)cc2)CC1)N(C)C	ZINC000160573796	432728727	/nfs/dbraw/zinc/72/87/27/432728727.db2.gz	KMDKUVYJVAYJHW-SFHVURJKSA-N	0	3	318.461	3.095	10	70		DGIEHN
CCC[C@@H](C(=O)N(C)Cc1ccc(C(F)(F)F)cc1)N(C)C	ZINC000161222927	546067444	/nfs/dbraw/zinc/06/74/44/546067444.db2.gz	IIFMIRQZDOMFML-AWEZNQCLSA-N	0	3	316.367	3.394	10	70		DGIEHN
Cc1nccn1C[C@@H]1CCCN1CCC(=O)c1ccc(C)cc1	ZINC000160024323	197380574	/nfs/dbraw/zinc/38/05/74/197380574.db2.gz	XIGLABBVXLWLEC-SFHVURJKSA-N	0	3	311.429	3.237	10	70		DGIEHN
CC(C)n1cc([C@H](C)NCCOc2ccc(F)cc2F)cn1	ZINC000160092545	432707358	/nfs/dbraw/zinc/70/73/58/432707358.db2.gz	QOHHPKDTDSMKCH-LBPRGKRZSA-N	0	3	309.360	3.472	10	70		DGIEHN
CC[C@H](C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C)c1ccc(F)cc1	ZINC000161020127	432754277	/nfs/dbraw/zinc/75/42/77/432754277.db2.gz	BGRMQIIZSQVZRF-RRQGHBQHSA-N	0	3	306.425	3.164	10	70		DGIEHN
CCOc1ccccc1CN1CCC[C@@H](Cc2noc(C)n2)C1	ZINC000161046986	432756516	/nfs/dbraw/zinc/75/65/16/432756516.db2.gz	WCNWMUPXPGJYNA-HNNXBMFYSA-N	0	3	315.417	3.231	10	70		DGIEHN
CC[C@@H](C(=O)N(C)C[C@@H]1CCCN1CC)c1ccc(F)cc1	ZINC000160702583	432735246	/nfs/dbraw/zinc/73/52/46/432735246.db2.gz	LRSISLSAQCFBIJ-DLBZAZTESA-N	0	3	306.425	3.262	10	70		DGIEHN
CCc1oc(C(=O)N[C@H](CN(C)C)c2ccccc2)cc1C	ZINC000159842823	292801489	/nfs/dbraw/zinc/80/14/89/292801489.db2.gz	KHIPLTOFBVZJBB-OAHLLOKOSA-N	0	3	300.402	3.183	10	70		DGIEHN
COc1cc(C(=O)N[C@H](CC(C)C)CN(C)C)ccc1Cl	ZINC000160244930	292810874	/nfs/dbraw/zinc/81/08/74/292810874.db2.gz	AWGOPRULKNRFGW-CYBMUJFWSA-N	0	3	312.841	3.055	10	70		DGIEHN
CC[C@@H](C(=O)N1CCC[C@H](c2nc(C(C)C)cs2)C1)N(C)C	ZINC000160477472	521819046	/nfs/dbraw/zinc/81/90/46/521819046.db2.gz	KHUTUCARKAHKNJ-ZFWWWQNUSA-N	0	3	323.506	3.313	10	70		DGIEHN
CCC[C@H](C(=O)N(C)Cc1ccc(C(F)(F)F)cc1)N(C)C	ZINC000161223053	546066643	/nfs/dbraw/zinc/06/66/43/546066643.db2.gz	IIFMIRQZDOMFML-CQSZACIVSA-N	0	3	316.367	3.394	10	70		DGIEHN
COc1cccc(OCCN(CCc2nccs2)C(C)C)c1	ZINC000159957318	432702836	/nfs/dbraw/zinc/70/28/36/432702836.db2.gz	FHVNKJYTCAZCOU-UHFFFAOYSA-N	0	3	320.458	3.484	10	70		DGIEHN
CCC(C)(C)c1ccc(CNC(=O)NC2CCN(C)CC2)cc1	ZINC000159566184	432686739	/nfs/dbraw/zinc/68/67/39/432686739.db2.gz	HRQOIIMLRIPTST-UHFFFAOYSA-N	0	3	317.477	3.268	10	70		DGIEHN
O=c1ccc2c([nH]1)CCC[C@H]2NCc1ccc(F)c(Cl)c1	ZINC000161003537	432754830	/nfs/dbraw/zinc/75/48/30/432754830.db2.gz	MWFVTMZDRZPSDW-CQSZACIVSA-N	0	3	306.768	3.335	10	70		DGIEHN
CN1CCC(NC(=O)N[C@@H]2c3ccccc3CCC2(C)C)CC1	ZINC000159569288	432687038	/nfs/dbraw/zinc/68/70/38/432687038.db2.gz	HGUMCJBABVYSTG-QGZVFWFLSA-N	0	3	315.461	3.094	10	70		DGIEHN
O=c1ccc2c([nH]1)CCC[C@@H]2NCc1ccc(F)c(Cl)c1	ZINC000161003641	432754814	/nfs/dbraw/zinc/75/48/14/432754814.db2.gz	MWFVTMZDRZPSDW-AWEZNQCLSA-N	0	3	306.768	3.335	10	70		DGIEHN
CCn1cnnc1[C@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1	ZINC000161295984	432771785	/nfs/dbraw/zinc/77/17/85/432771785.db2.gz	DGNKUGXXSVGQAJ-ZFWWWQNUSA-N	0	3	302.397	3.378	10	70		DGIEHN
Cc1[nH]c2c(cccc2C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1C	ZINC000161395405	432775821	/nfs/dbraw/zinc/77/58/21/432775821.db2.gz	MFFDTRXQLIVWFI-YVEFUNNKSA-N	0	3	313.445	3.243	10	70		DGIEHN
C[C@]1(CNc2ncc(F)cn2)CCCN1Cc1ccccc1	ZINC000160800239	432743007	/nfs/dbraw/zinc/74/30/07/432743007.db2.gz	GMFCSEOSRGCRDL-QGZVFWFLSA-N	0	3	300.381	3.082	10	70		DGIEHN
CC(C)c1noc(CCCN[C@H](C)c2cnn(C(C)C)c2)n1	ZINC000160821772	432743704	/nfs/dbraw/zinc/74/37/04/432743704.db2.gz	ZIEPNKDMNMHBHN-CYBMUJFWSA-N	0	3	305.426	3.254	10	70		DGIEHN
COc1ccccc1[C@H](C)NCCCc1nc(C(C)C)no1	ZINC000160788130	524780603	/nfs/dbraw/zinc/78/06/03/524780603.db2.gz	KIVLQMMFQHJSFB-ZDUSSCGKSA-N	0	3	303.406	3.485	10	70		DGIEHN
CO[C@@]1(CN[C@H]2CCCc3sc(Cl)cc32)CCOC1	ZINC000160099493	432706457	/nfs/dbraw/zinc/70/64/57/432706457.db2.gz	YBYZDHPMKKOBQW-SMDDNHRTSA-N	0	3	301.839	3.174	10	70		DGIEHN
CC[C@H](C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)c1ccc(F)cc1	ZINC000160420606	432719792	/nfs/dbraw/zinc/71/97/92/432719792.db2.gz	KBXQVIFBEATCBL-XYPHTWIQSA-N	0	3	306.425	3.260	10	70		DGIEHN
C[C@H](N[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccn1	ZINC000159366208	432681317	/nfs/dbraw/zinc/68/13/17/432681317.db2.gz	XJHGFKHKZYJZPZ-QWHCGFSZSA-N	0	3	302.809	3.060	10	70		DGIEHN
CCN(CCc1nccs1)Cc1cc(C(=O)OC)sc1C	ZINC000159409864	432681760	/nfs/dbraw/zinc/68/17/60/432681760.db2.gz	YLTBOTOLWZHZTK-UHFFFAOYSA-N	0	3	324.471	3.364	10	70		DGIEHN
C[C@H](c1cccnc1)N(C)CCN(C)Cc1ccc(F)cc1	ZINC000161188664	432764424	/nfs/dbraw/zinc/76/44/24/432764424.db2.gz	SIDCYSQHLAZLCS-OAHLLOKOSA-N	0	3	301.409	3.346	10	70		DGIEHN
Cc1ccc([C@H](C)NC(=O)N(CCN(C)C)C(C)C)cc1F	ZINC000159571862	228242301	/nfs/dbraw/zinc/24/23/01/228242301.db2.gz	WFAXQGAHZKNNHH-AWEZNQCLSA-N	0	3	309.429	3.177	10	70		DGIEHN
Cc1ccc2cc(C(=O)N[C@H](CC(C)C)CN(C)C)ccc2n1	ZINC000160364287	432717959	/nfs/dbraw/zinc/71/79/59/432717959.db2.gz	FHTUJIYFSLCNOI-QGZVFWFLSA-N	0	3	313.445	3.249	10	70		DGIEHN
CN1CCC(NC(=O)N[C@H]2c3ccccc3CCC2(C)C)CC1	ZINC000159569149	432686801	/nfs/dbraw/zinc/68/68/01/432686801.db2.gz	HGUMCJBABVYSTG-KRWDZBQOSA-N	0	3	315.461	3.094	10	70		DGIEHN
C[C@@]1(CNc2ncc(F)cn2)CCCN1Cc1ccccc1	ZINC000160800415	432742950	/nfs/dbraw/zinc/74/29/50/432742950.db2.gz	GMFCSEOSRGCRDL-KRWDZBQOSA-N	0	3	300.381	3.082	10	70		DGIEHN
Fc1cc(Cl)cc(CNC[C@H]2COc3ccccc3O2)c1	ZINC000160819772	432744701	/nfs/dbraw/zinc/74/47/01/432744701.db2.gz	GCINAPPLCPDOTE-AWEZNQCLSA-N	0	3	307.752	3.409	10	70		DGIEHN
O=C1CCCN1CCCN[C@H]1CCCOc2c(Cl)cccc21	ZINC000159491425	304626373	/nfs/dbraw/zinc/62/63/73/304626373.db2.gz	JBZSDCYQWRCHAT-HNNXBMFYSA-N	0	3	322.836	3.156	10	70		DGIEHN
Cc1cc(F)c(C(=O)N[C@H](CN(C)C)c2ccccc2)cc1F	ZINC000160203877	546059522	/nfs/dbraw/zinc/05/95/22/546059522.db2.gz	MZBJSVMGLORUSH-QGZVFWFLSA-N	0	3	318.367	3.306	10	70		DGIEHN
C[C@@H]1OCC[C@@H]1NCc1ccc(Br)c2cccnc12	ZINC000160339166	546060146	/nfs/dbraw/zinc/06/01/46/546060146.db2.gz	ZJMJEWVGOVFZKC-HZMBPMFUSA-N	0	3	321.218	3.264	10	70		DGIEHN
CC(C)COc1ccc([C@@H](C)NC(=O)C2CCN(C)CC2)cc1	ZINC000159653548	186133110	/nfs/dbraw/zinc/13/31/10/186133110.db2.gz	VIHXAIGSHDOWHG-OAHLLOKOSA-N	0	3	318.461	3.240	10	70		DGIEHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Nc1ccnc(C2CC2)n1	ZINC000160234508	197395213	/nfs/dbraw/zinc/39/52/13/197395213.db2.gz	FWSSCPYCRYTNJR-YOEHRIQHSA-N	0	3	308.429	3.286	10	70		DGIEHN
C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C)CC2)c2ccccc21	ZINC000159570273	278585798	/nfs/dbraw/zinc/58/57/98/278585798.db2.gz	UDYQGTQOTKFQHK-CXAGYDPISA-N	0	3	301.434	3.018	10	70		DGIEHN
CCc1oc(C(=O)N(CCN(C)C)Cc2ccccc2)cc1C	ZINC000159797868	432696956	/nfs/dbraw/zinc/69/69/56/432696956.db2.gz	NSVPZZWUAMLYLT-UHFFFAOYSA-N	0	3	314.429	3.354	10	70		DGIEHN
CC(C)CN1CCC[C@@H]1CNC(=O)CSc1ccccc1	ZINC000160420181	432719620	/nfs/dbraw/zinc/71/96/20/432719620.db2.gz	PVGIMVHBMDZMJS-OAHLLOKOSA-N	0	3	306.475	3.015	10	70		DGIEHN
C[C@H](c1ccncc1)N(C)CCN(C)Cc1ccc(F)cc1	ZINC000161187109	432764564	/nfs/dbraw/zinc/76/45/64/432764564.db2.gz	YNLYWXJFZIZXAB-OAHLLOKOSA-N	0	3	301.409	3.346	10	70		DGIEHN
C[C@H](c1ccccn1)N(C)CCN(C)Cc1ccc(F)cc1	ZINC000161189989	432765072	/nfs/dbraw/zinc/76/50/72/432765072.db2.gz	VGJWSBAZMSHEFE-OAHLLOKOSA-N	0	3	301.409	3.346	10	70		DGIEHN
CCn1cnnc1[C@H]1CCCN(Cc2ccc(Cl)cc2)C1	ZINC000161338073	432773238	/nfs/dbraw/zinc/77/32/38/432773238.db2.gz	SXCZQUVSVMZGHC-AWEZNQCLSA-N	0	3	304.825	3.331	10	70		DGIEHN
Cc1c2cc(C)ccc2[nH]c1C(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000161340903	432774427	/nfs/dbraw/zinc/77/44/27/432774427.db2.gz	QYDYNNNKVFKESL-OAHLLOKOSA-N	0	3	311.429	3.095	10	70		DGIEHN
CCN(CCOc1ccc(OC)cc1)CCc1nccs1	ZINC000159431052	197352935	/nfs/dbraw/zinc/35/29/35/197352935.db2.gz	OGNJGKXQXVGIOX-UHFFFAOYSA-N	0	3	306.431	3.095	10	70		DGIEHN
O[C@]12CCCC[C@@H]1CN(CCOc1cccc(Cl)c1)CC2	ZINC000160750354	228247880	/nfs/dbraw/zinc/24/78/80/228247880.db2.gz	AFIVOMRZHRKFAI-PBHICJAKSA-N	0	3	309.837	3.346	10	70		DGIEHN
CCC[C@H](C(=O)N1CCC(Oc2ccc(C)cc2)CC1)N(C)C	ZINC000160573945	276281570	/nfs/dbraw/zinc/28/15/70/276281570.db2.gz	KMDKUVYJVAYJHW-GOSISDBHSA-N	0	3	318.461	3.095	10	70		DGIEHN
CC(C)N(CCc1nccs1)Cc1cnc2ccccn12	ZINC000159799118	432697367	/nfs/dbraw/zinc/69/73/67/432697367.db2.gz	NTKNJLCXLBQHOY-UHFFFAOYSA-N	0	3	300.431	3.244	10	70		DGIEHN
CC(C)n1cc([C@@H](C)NCCOc2ccc(F)cc2F)cn1	ZINC000160092422	432707484	/nfs/dbraw/zinc/70/74/84/432707484.db2.gz	QOHHPKDTDSMKCH-GFCCVEGCSA-N	0	3	309.360	3.472	10	70		DGIEHN
C[C@H](N[C@H]1CCN(c2ncccc2Cl)C1)c1ccccn1	ZINC000159366473	432682193	/nfs/dbraw/zinc/68/21/93/432682193.db2.gz	XJHGFKHKZYJZPZ-STQMWFEESA-N	0	3	302.809	3.060	10	70		DGIEHN
CS[C@@H](C)CC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000161414871	432777936	/nfs/dbraw/zinc/77/79/36/432777936.db2.gz	VSSWEFIAGUAUMH-DOTOQJQBSA-N	0	3	320.502	3.299	10	70		DGIEHN
CCC[C@@H](C(=O)N(C)Cc1ccccc1C(F)(F)F)N(C)C	ZINC000161413328	432778152	/nfs/dbraw/zinc/77/81/52/432778152.db2.gz	OSCGZPDXJKTQID-AWEZNQCLSA-N	0	3	316.367	3.394	10	70		DGIEHN
C/C(=C/c1ccc(Cl)cc1)CNCC(=O)NCC(F)(F)F	ZINC000160038160	292805783	/nfs/dbraw/zinc/80/57/83/292805783.db2.gz	TZUCISAGEDICLH-POHAHGRESA-N	0	3	320.742	3.011	10	70		DGIEHN
CC(C)[C@H](C)N[C@H](C)C(=O)Nc1ccccc1OC(F)F	ZINC000160452516	519813155	/nfs/dbraw/zinc/81/31/55/519813155.db2.gz	NUFGCDQVYGLGGV-WDEREUQCSA-N	0	3	300.349	3.249	10	70		DGIEHN
C[C@H]1OCC[C@H]1NCc1ccc(Br)c2cccnc12	ZINC000160338767	197402101	/nfs/dbraw/zinc/40/21/01/197402101.db2.gz	ZJMJEWVGOVFZKC-QMTHXVAHSA-N	0	3	321.218	3.264	10	70		DGIEHN
C[C@H](NCCN1CCSCC1)c1ccc(Cl)c(F)c1	ZINC000218248020	284785870	/nfs/dbraw/zinc/78/58/70/284785870.db2.gz	CSFDFEMRXCXWGS-NSHDSACASA-N	0	3	302.846	3.179	10	70		DGIEHN
CC[C@H](C(=O)N1CCC[C@H](c2nc(C(C)C)cs2)C1)N(C)C	ZINC000160477586	287464098	/nfs/dbraw/zinc/46/40/98/287464098.db2.gz	KHUTUCARKAHKNJ-DZGCQCFKSA-N	0	3	323.506	3.313	10	70		DGIEHN
COc1ccc2c(c1)[C@H](NC[C@@H]1CCCC[C@@H]1O)CCCO2	ZINC000160467066	277989176	/nfs/dbraw/zinc/98/91/76/277989176.db2.gz	SYJYVUGJBZWZAX-XKQJLSEDSA-N	0	3	305.418	3.050	10	70		DGIEHN
COC(=O)c1cccc(CN(CCc2nccs2)C(C)C)c1	ZINC000159875957	432698976	/nfs/dbraw/zinc/69/89/76/432698976.db2.gz	RZTPSKDBNYPLNG-UHFFFAOYSA-N	0	3	318.442	3.383	10	70		DGIEHN
CCC[C@@H](C(=O)N1CCC(Cc2ccccc2)CC1)N(C)C	ZINC000161155751	432762672	/nfs/dbraw/zinc/76/26/72/432762672.db2.gz	JVGJLGSMSPHHOU-SFHVURJKSA-N	0	3	302.462	3.198	10	70		DGIEHN
CCC[C@H](C(=O)N[C@H]1CCSc2ccc(F)cc21)N(C)C	ZINC000161335035	432772446	/nfs/dbraw/zinc/77/24/46/432772446.db2.gz	DFWYLGKNSUXKQF-UONOGXRCSA-N	0	3	310.438	3.209	10	70		DGIEHN
CCn1cnnc1[C@H]1CCCN(Cc2ccccc2Cl)C1	ZINC000161338878	432772683	/nfs/dbraw/zinc/77/26/83/432772683.db2.gz	GDWHEIGLZBXMKS-AWEZNQCLSA-N	0	3	304.825	3.331	10	70		DGIEHN
CCC[C@@H](C(=O)N[C@H](C)c1ccc(OC(F)F)cc1)N(C)C	ZINC000161453814	432779985	/nfs/dbraw/zinc/77/99/85/432779985.db2.gz	JUWMGRSHBNCZRR-RISCZKNCSA-N	0	3	314.376	3.196	10	70		DGIEHN
CC[C@H](C(=O)N(C)C[C@@H]1CCCN1CC)c1ccc(F)cc1	ZINC000160702420	432736174	/nfs/dbraw/zinc/73/61/74/432736174.db2.gz	LRSISLSAQCFBIJ-IRXDYDNUSA-N	0	3	306.425	3.262	10	70		DGIEHN
CCC[C@@H](C(=O)N[C@@H]1CCSc2ccc(F)cc21)N(C)C	ZINC000161334653	432772522	/nfs/dbraw/zinc/77/25/22/432772522.db2.gz	DFWYLGKNSUXKQF-KGLIPLIRSA-N	0	3	310.438	3.209	10	70		DGIEHN
CCn1cnnc1[C@@H]1CCCN(Cc2ccc(Cl)cc2)C1	ZINC000161337938	432772603	/nfs/dbraw/zinc/77/26/03/432772603.db2.gz	SXCZQUVSVMZGHC-CQSZACIVSA-N	0	3	304.825	3.331	10	70		DGIEHN
CCC[C@H](C(=O)NCCCO[C@H](C)c1ccccc1)N(C)C	ZINC000161309077	432773507	/nfs/dbraw/zinc/77/35/07/432773507.db2.gz	HDYLCHDSSKOQQV-NVXWUHKLSA-N	0	3	306.450	3.001	10	70		DGIEHN
CCC[C@H](C(=O)NCc1ccc(C(F)(F)F)cc1)N(C)C	ZINC000161342050	432775144	/nfs/dbraw/zinc/77/51/44/432775144.db2.gz	NTTJHZOCZDTTQO-CYBMUJFWSA-N	0	3	302.340	3.052	10	70		DGIEHN
Cc1[nH]c2c(cccc2C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1C	ZINC000161395541	432777060	/nfs/dbraw/zinc/77/70/60/432777060.db2.gz	MFFDTRXQLIVWFI-SJCJKPOMSA-N	0	3	313.445	3.243	10	70		DGIEHN
CC[C@H](C(=O)N(C)C[C@H]1CCCN1CC)c1ccc(F)cc1	ZINC000160702699	432735874	/nfs/dbraw/zinc/73/58/74/432735874.db2.gz	LRSISLSAQCFBIJ-SJORKVTESA-N	0	3	306.425	3.262	10	70		DGIEHN
Cc1nnc(NC[C@]2(C)CCCN2Cc2ccccc2)s1	ZINC000160801397	432742441	/nfs/dbraw/zinc/74/24/41/432742441.db2.gz	OHDKAYCTDXFJQI-INIZCTEOSA-N	0	3	302.447	3.313	10	70		DGIEHN
C[C@@H](c1cccnc1)N(C)CCN(C)Cc1ccc(F)cc1	ZINC000161188533	274278649	/nfs/dbraw/zinc/27/86/49/274278649.db2.gz	SIDCYSQHLAZLCS-HNNXBMFYSA-N	0	3	301.409	3.346	10	70		DGIEHN
COC(=O)c1cc(CN(CCc2nccs2)C(C)C)oc1C	ZINC000159869639	432699322	/nfs/dbraw/zinc/69/93/22/432699322.db2.gz	VEQJCAMUAXXTSC-UHFFFAOYSA-N	0	3	322.430	3.284	10	70		DGIEHN
CO[C@@]1(CN[C@@H]2CCCc3sc(Cl)cc32)CCOC1	ZINC000160099228	432706216	/nfs/dbraw/zinc/70/62/16/432706216.db2.gz	YBYZDHPMKKOBQW-BXUZGUMPSA-N	0	3	301.839	3.174	10	70		DGIEHN
CCn1cnnc1[C@@H]1CCCN(CCc2ccccc2Cl)C1	ZINC000161343570	432774388	/nfs/dbraw/zinc/77/43/88/432774388.db2.gz	JEIWCMFKKZTUDE-OAHLLOKOSA-N	0	3	318.852	3.374	10	70		DGIEHN
C[C@@H]1CCC[C@H](OCCCCCC(=O)N2CC[C@H](N(C)C)C2)C1	ZINC000161373180	432776334	/nfs/dbraw/zinc/77/63/34/432776334.db2.gz	VVLQRIUMDYFUQJ-SQNIBIBYSA-N	0	3	324.509	3.305	10	70		DGIEHN
Cc1nccn1C[C@H]1CCCN1CCC(=O)c1ccc(C)cc1	ZINC000160024194	197379889	/nfs/dbraw/zinc/37/98/89/197379889.db2.gz	XIGLABBVXLWLEC-GOSISDBHSA-N	0	3	311.429	3.237	10	70		DGIEHN
CN(Cc1ccc(Br)c(F)c1)C[C@H]1CCC[C@@H]1O	ZINC000159770509	432695154	/nfs/dbraw/zinc/69/51/54/432695154.db2.gz	DHANBDFCZPINQH-RISCZKNCSA-N	0	3	316.214	3.181	10	70		DGIEHN
COC(=O)c1ccc(CN(CCc2nccs2)C(C)C)cc1	ZINC000159841906	432696862	/nfs/dbraw/zinc/69/68/62/432696862.db2.gz	KSFDJDYVFGMTLK-UHFFFAOYSA-N	0	3	318.442	3.383	10	70		DGIEHN
C[C@@H]1CC[C@@H](NC(=O)NC[C@@H]2CCCN(C)C2)c2ccccc21	ZINC000159805955	432697143	/nfs/dbraw/zinc/69/71/43/432697143.db2.gz	DJGNLODHQTUKJR-RVKKMQEKSA-N	0	3	315.461	3.266	10	70		DGIEHN
CCCn1cc(CNC(C)(C)CN(C)Cc2ccccc2)cn1	ZINC000159390445	432682083	/nfs/dbraw/zinc/68/20/83/432682083.db2.gz	BAVBHYQTMMGGBJ-UHFFFAOYSA-N	0	3	314.477	3.293	10	70		DGIEHN
C[C@H]1CC[C@@H](NC(=O)NC2CCN(C)CC2)c2ccccc21	ZINC000159570395	432688079	/nfs/dbraw/zinc/68/80/79/432688079.db2.gz	UDYQGTQOTKFQHK-SUMWQHHRSA-N	0	3	301.434	3.018	10	70		DGIEHN
CCn1cnnc1[C@H]1CCCN([C@@H](C)c2ccccc2F)C1	ZINC000161267330	432770248	/nfs/dbraw/zinc/77/02/48/432770248.db2.gz	NXTLWHKIJCLXDW-KBPBESRZSA-N	0	3	302.397	3.378	10	70		DGIEHN
CC[C@@H](C(=O)N(C)C[C@H]1CCCN1CC)c1ccc(F)cc1	ZINC000160702828	432735772	/nfs/dbraw/zinc/73/57/72/432735772.db2.gz	LRSISLSAQCFBIJ-IAGOWNOFSA-N	0	3	306.425	3.262	10	70		DGIEHN
CSc1ccc(OCCN2CC[C@@]3(O)CCCC[C@@H]3C2)cc1	ZINC000160711036	432737762	/nfs/dbraw/zinc/73/77/62/432737762.db2.gz	TVHVTTCQHHRATG-QAPCUYQASA-N	0	3	321.486	3.414	10	70		DGIEHN
CCOC(=O)C[C@@H](N)c1ccc(Br)cc1Cl	ZINC000161039474	400737295	/nfs/dbraw/zinc/73/72/95/400737295.db2.gz	SMLHHFQQNNTVHX-SNVBAGLBSA-N	0	3	306.587	3.056	10	70		DGIEHN
CCOC(=O)C[C@H](N)c1ccc(Br)cc1Cl	ZINC000161039346	400737765	/nfs/dbraw/zinc/73/77/65/400737765.db2.gz	SMLHHFQQNNTVHX-JTQLQIEISA-N	0	3	306.587	3.056	10	70		DGIEHN
CCN(CC)CC(=O)N[C@H](C)c1ccc(OCC(C)C)cc1	ZINC000159778615	432696432	/nfs/dbraw/zinc/69/64/32/432696432.db2.gz	RSSURYHJQIPTAK-OAHLLOKOSA-N	0	3	306.450	3.240	10	70		DGIEHN
C[C@]1(C(=O)NC2CCN(C3CC3)CC2)CCCc2ccccc21	ZINC000159378806	432682510	/nfs/dbraw/zinc/68/25/10/432682510.db2.gz	AEGNOGLVBGIUSU-FQEVSTJZSA-N	0	3	312.457	3.024	10	70		DGIEHN
CSc1ccsc1C(=O)NC[C@H]1CCCN1CC(C)C	ZINC000160551720	432729321	/nfs/dbraw/zinc/72/93/21/432729321.db2.gz	BLEOZVKJLXVILU-GFCCVEGCSA-N	0	3	312.504	3.320	10	70		DGIEHN
COC[C@H]1CCCN(C[C@@H]2CC(c3ccc(Cl)cc3)=NO2)C1	ZINC000159821965	197367550	/nfs/dbraw/zinc/36/75/50/197367550.db2.gz	NNFCTRONTYOIRB-BBRMVZONSA-N	0	3	322.836	3.191	10	70		DGIEHN
C[C@@H](NCCN1CCSCC1)c1ccc(Cl)c(F)c1	ZINC000218247961	432657894	/nfs/dbraw/zinc/65/78/94/432657894.db2.gz	CSFDFEMRXCXWGS-LLVKDONJSA-N	0	3	302.846	3.179	10	70		DGIEHN
COc1ccccc1OCCN(CCc1nccs1)C(C)C	ZINC000159864494	432700068	/nfs/dbraw/zinc/70/00/68/432700068.db2.gz	RZFWKHSETUVPBL-UHFFFAOYSA-N	0	3	320.458	3.484	10	70		DGIEHN
FC(F)Oc1ccc(CN2CCC(c3cc[nH]n3)CC2)cc1	ZINC000160546851	432726621	/nfs/dbraw/zinc/72/66/21/432726621.db2.gz	ZEUARRVDSMOQRS-UHFFFAOYSA-N	0	3	307.344	3.391	10	70		DGIEHN
CCC[C@H](C(=O)N[C@@H]1CCSc2ccc(F)cc21)N(C)C	ZINC000161334781	432773350	/nfs/dbraw/zinc/77/33/50/432773350.db2.gz	DFWYLGKNSUXKQF-ZIAGYGMSSA-N	0	3	310.438	3.209	10	70		DGIEHN
CC(C)c1noc(CCCN[C@@H](C)c2cnn(C(C)C)c2)n1	ZINC000160821658	432743943	/nfs/dbraw/zinc/74/39/43/432743943.db2.gz	ZIEPNKDMNMHBHN-ZDUSSCGKSA-N	0	3	305.426	3.254	10	70		DGIEHN
CCN(CC)CC(=O)N[C@@H](C)c1ccc(OCC(C)C)cc1	ZINC000159778481	292800081	/nfs/dbraw/zinc/80/00/81/292800081.db2.gz	RSSURYHJQIPTAK-HNNXBMFYSA-N	0	3	306.450	3.240	10	70		DGIEHN
CCC[C@H](C(=O)N[C@H](C)c1ccc(OC(F)F)cc1)N(C)C	ZINC000161453934	197496668	/nfs/dbraw/zinc/49/66/68/197496668.db2.gz	JUWMGRSHBNCZRR-BXUZGUMPSA-N	0	3	314.376	3.196	10	70		DGIEHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Nc1ccnc(C2CC2)n1	ZINC000160234381	197395312	/nfs/dbraw/zinc/39/53/12/197395312.db2.gz	FWSSCPYCRYTNJR-PBHICJAKSA-N	0	3	308.429	3.286	10	70		DGIEHN
CCOc1ccc(Cl)cc1[C@@H](C)NCCCN1CCCC1=O	ZINC000159503359	197359025	/nfs/dbraw/zinc/35/90/25/197359025.db2.gz	VRODINMECLDELA-CYBMUJFWSA-N	0	3	324.852	3.402	10	70		DGIEHN
Cc1ccc([C@@H](C)NC(=O)N(CCN(C)C)C(C)C)cc1F	ZINC000159571719	228243114	/nfs/dbraw/zinc/24/31/14/228243114.db2.gz	WFAXQGAHZKNNHH-CQSZACIVSA-N	0	3	309.429	3.177	10	70		DGIEHN
CC(C)[C@H](C)N[C@@H](C)C(=O)Nc1ccccc1OC(F)F	ZINC000160452241	432721361	/nfs/dbraw/zinc/72/13/61/432721361.db2.gz	NUFGCDQVYGLGGV-QWRGUYRKSA-N	0	3	300.349	3.249	10	70		DGIEHN
Cc1ccccc1[C@@H](C)N[C@H](C)C(=O)NCc1ccc(F)cc1	ZINC000159435506	432682794	/nfs/dbraw/zinc/68/27/94/432682794.db2.gz	ZEYYTAZXSKXLFF-HUUCEWRRSA-N	0	3	314.404	3.490	10	70		DGIEHN
CCn1cnnc1[C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1	ZINC000161295865	432771225	/nfs/dbraw/zinc/77/12/25/432771225.db2.gz	DGNKUGXXSVGQAJ-DZGCQCFKSA-N	0	3	302.397	3.378	10	70		DGIEHN
Cc1c2cc(C)ccc2[nH]c1C(=O)N1CC[C@H](N2CCCC2)C1	ZINC000161340816	432774144	/nfs/dbraw/zinc/77/41/44/432774144.db2.gz	QYDYNNNKVFKESL-HNNXBMFYSA-N	0	3	311.429	3.095	10	70		DGIEHN
COc1ccc(CN2CC[C@]3(O)CCCC[C@@H]3C2)cc1Cl	ZINC000161395112	432776399	/nfs/dbraw/zinc/77/63/99/432776399.db2.gz	RNONDLOUUVPMQJ-RHSMWYFYSA-N	0	3	309.837	3.476	10	70		DGIEHN
CCC[C@H](C(=O)NCCCSc1ccc(F)cc1)N(C)C	ZINC000161441865	432778937	/nfs/dbraw/zinc/77/89/37/432778937.db2.gz	YCZFVTIVLBAPFS-OAHLLOKOSA-N	0	3	312.454	3.154	10	70		DGIEHN
CC[C@@H](C(=O)N1CCC[C@@H](c2nc(C(C)C)cs2)C1)N(C)C	ZINC000160477722	521815560	/nfs/dbraw/zinc/81/55/60/521815560.db2.gz	KHUTUCARKAHKNJ-HIFRSBDPSA-N	0	3	323.506	3.313	10	70		DGIEHN
CC(C)COc1ccc([C@@H](C)NC(=O)CN(C)C(C)C)cc1	ZINC000159766401	432696483	/nfs/dbraw/zinc/69/64/83/432696483.db2.gz	MEFRJYYSGFPZFY-OAHLLOKOSA-N	0	3	306.450	3.239	10	70		DGIEHN
CCN1CCC[C@@H]1CN(C)C(=O)C[C@@H](C)c1ccc(F)cc1F	ZINC000159996261	432702824	/nfs/dbraw/zinc/70/28/24/432702824.db2.gz	KOKOCBJKCCDEMR-UKRRQHHQSA-N	0	3	324.415	3.401	10	70		DGIEHN
Cc1ccc([O-])c(C[NH2+]C(C)(C)CN(C)Cc2ccccc2)n1	ZINC000159389599	432682359	/nfs/dbraw/zinc/68/23/59/432682359.db2.gz	MWNKLBUFZYRNFQ-UHFFFAOYSA-N	0	3	313.445	3.096	10	70		DGIEHN
CCC[C@H](C(=O)N1CCC(Cc2ccccc2)CC1)N(C)C	ZINC000161155852	432763862	/nfs/dbraw/zinc/76/38/62/432763862.db2.gz	JVGJLGSMSPHHOU-GOSISDBHSA-N	0	3	302.462	3.198	10	70		DGIEHN
CCn1cnnc1[C@H]1CCCN(Cc2cccc(Cl)c2)C1	ZINC000161308724	432772277	/nfs/dbraw/zinc/77/22/77/432772277.db2.gz	JJIKKSVVRVQXMK-AWEZNQCLSA-N	0	3	304.825	3.331	10	70		DGIEHN
CC[C@@](C)(O)CN(C)Cc1c(C)nn(-c2ccccc2C)c1C	ZINC000160680310	529508169	/nfs/dbraw/zinc/50/81/69/529508169.db2.gz	GRGJFYAMZCJSNY-LJQANCHMSA-N	0	3	315.461	3.390	10	70		DGIEHN
O[C@]12CCCC[C@@H]1CN(CCOc1ccc(Cl)cc1)CC2	ZINC000160807386	228249455	/nfs/dbraw/zinc/24/94/55/228249455.db2.gz	FKLBTUCLTLPIBK-PBHICJAKSA-N	0	3	309.837	3.346	10	70		DGIEHN
CC(C)N(CCc1nccs1)Cc1ccc2c(c1)OCCO2	ZINC000159825060	432697514	/nfs/dbraw/zinc/69/75/14/432697514.db2.gz	RRVGIBFHVJZARF-UHFFFAOYSA-N	0	3	318.442	3.367	10	70		DGIEHN
CCN1CCC[C@H]1CN(C)C(=O)C[C@@H](C)c1ccc(F)cc1F	ZINC000159996393	432702540	/nfs/dbraw/zinc/70/25/40/432702540.db2.gz	KOKOCBJKCCDEMR-HIFRSBDPSA-N	0	3	324.415	3.401	10	70		DGIEHN
Cc1ccccc1[C@@H](C)N[C@@H](C)C(=O)NCc1ccc(F)cc1	ZINC000159435346	432683704	/nfs/dbraw/zinc/68/37/04/432683704.db2.gz	ZEYYTAZXSKXLFF-CABCVRRESA-N	0	3	314.404	3.490	10	70		DGIEHN
CCn1cnnc1[C@H]1CCCN(CCc2ccccc2Cl)C1	ZINC000161343677	432774536	/nfs/dbraw/zinc/77/45/36/432774536.db2.gz	JEIWCMFKKZTUDE-HNNXBMFYSA-N	0	3	318.852	3.374	10	70		DGIEHN
CS[C@H](C)CC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000161414990	432778682	/nfs/dbraw/zinc/77/86/82/432778682.db2.gz	VSSWEFIAGUAUMH-NVXWUHKLSA-N	0	3	320.502	3.299	10	70		DGIEHN
O[C@H](CN1CC[C@]2(O)CCCC[C@@H]2C1)c1ccc(Cl)cc1	ZINC000160633470	432732280	/nfs/dbraw/zinc/73/22/80/432732280.db2.gz	FBQFXCVRGXLXQS-DJIMGWMZSA-N	0	3	309.837	3.000	10	70		DGIEHN
Cn1ccnc1CC1CCN(c2ccnc3ccccc32)CC1	ZINC000160689347	432735412	/nfs/dbraw/zinc/73/54/12/432735412.db2.gz	XVSYUYKDJBGZHJ-UHFFFAOYSA-N	0	3	306.413	3.427	10	70		DGIEHN
c1ccc2c(c1)CC[C@@H]2NCc1ccc(CN2CCOCC2)cc1	ZINC000160584475	292817726	/nfs/dbraw/zinc/81/77/26/292817726.db2.gz	PPKOXEXCVXAFDP-NRFANRHFSA-N	0	3	322.452	3.296	10	70		DGIEHN
CC(C)[C@@H](C)N[C@@H](C)C(=O)Nc1ccccc1OC(F)F	ZINC000160452093	519792465	/nfs/dbraw/zinc/79/24/65/519792465.db2.gz	NUFGCDQVYGLGGV-MNOVXSKESA-N	0	3	300.349	3.249	10	70		DGIEHN
Brc1ccc(CN[C@@H]2CCCOC2)c2ncccc12	ZINC000160326540	546060349	/nfs/dbraw/zinc/06/03/49/546060349.db2.gz	IXOUXOALONRJMV-GFCCVEGCSA-N	0	3	321.218	3.266	10	70		DGIEHN
C[C@H]1CN(C[C@H](O)Cc2ccc(C(F)(F)F)cc2)CCS1	ZINC000159842335	432698307	/nfs/dbraw/zinc/69/83/07/432698307.db2.gz	HUACREJJIUQRDM-SMDDNHRTSA-N	0	3	319.392	3.046	10	70		DGIEHN
C[C@@H]1CCC[C@H](C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000161276964	432769188	/nfs/dbraw/zinc/76/91/88/432769188.db2.gz	BZDJHRSQUQYZOU-NJAFHUGGSA-N	0	3	302.462	3.102	10	70		DGIEHN
CCC[C@@H](C(=O)NCCCSc1ccc(F)cc1)N(C)C	ZINC000161441725	432779601	/nfs/dbraw/zinc/77/96/01/432779601.db2.gz	YCZFVTIVLBAPFS-HNNXBMFYSA-N	0	3	312.454	3.154	10	70		DGIEHN
C/C(=C\c1ccc(Cl)cc1)CNC[C@@H](O)COCC(C)C	ZINC000160117675	292807561	/nfs/dbraw/zinc/80/75/61/292807561.db2.gz	LQTLCESPXILLSX-LEHPZIBWSA-N	0	3	311.853	3.366	10	70		DGIEHN
c1ccc2c(c1)CC[C@H]2NCc1ccc(CN2CCOCC2)cc1	ZINC000160584601	292817888	/nfs/dbraw/zinc/81/78/88/292817888.db2.gz	PPKOXEXCVXAFDP-OAQYLSRUSA-N	0	3	322.452	3.296	10	70		DGIEHN
CCS[C@@H](C(=O)NC[C@H]1CCCN1CC(C)C)C(C)C	ZINC000160523864	432725125	/nfs/dbraw/zinc/72/51/25/432725125.db2.gz	YHCREKDECVKJES-HUUCEWRRSA-N	0	3	300.512	3.001	10	70		DGIEHN
CCC[C@@H](C(=O)N1CC=C(c2ccccc2F)CC1)N(C)C	ZINC000159621841	432690333	/nfs/dbraw/zinc/69/03/33/432690333.db2.gz	BEBIRGYQQAZBNG-KRWDZBQOSA-N	0	3	304.409	3.172	10	70		DGIEHN
CN(CCN(Cc1cccnc1)C1CC1)Cc1ccc(F)cc1	ZINC000161157761	432763350	/nfs/dbraw/zinc/76/33/50/432763350.db2.gz	GHRACDWDPCHWNM-UHFFFAOYSA-N	0	3	313.420	3.317	10	70		DGIEHN
CC[C@](C)(O)CN(C)Cc1cc(OC)c(OC)cc1SC	ZINC000161225331	529372689	/nfs/dbraw/zinc/37/26/89/529372689.db2.gz	FIKXJZVIMAYVCF-INIZCTEOSA-N	0	3	313.463	3.019	10	70		DGIEHN
C[C@H]1OCC[C@@H]1NCc1ccc(Br)c2cccnc12	ZINC000160339050	197401646	/nfs/dbraw/zinc/40/16/46/197401646.db2.gz	ZJMJEWVGOVFZKC-YGRLFVJLSA-N	0	3	321.218	3.264	10	70		DGIEHN
CC(C)CO[C@@H]1CCN(CCN(C)Cc2ccc(F)cc2)C1	ZINC000160170483	432710166	/nfs/dbraw/zinc/71/01/66/432710166.db2.gz	HQACDNVCNLYAPN-GOSISDBHSA-N	0	3	308.441	3.004	10	70		DGIEHN
Cc1ccc2cc(C(=O)N[C@@H](CC(C)C)CN(C)C)ccc2n1	ZINC000160364147	432717381	/nfs/dbraw/zinc/71/73/81/432717381.db2.gz	FHTUJIYFSLCNOI-KRWDZBQOSA-N	0	3	313.445	3.249	10	70		DGIEHN
C[C@@H](N[C@H]1CCN(c2ncccc2Cl)C1)c1ccccn1	ZINC000159366608	432682039	/nfs/dbraw/zinc/68/20/39/432682039.db2.gz	XJHGFKHKZYJZPZ-OLZOCXBDSA-N	0	3	302.809	3.060	10	70		DGIEHN
Cc1ccccc1[C@H](C)N[C@@H](C)C(=O)NCc1ccc(F)cc1	ZINC000159435444	432682934	/nfs/dbraw/zinc/68/29/34/432682934.db2.gz	ZEYYTAZXSKXLFF-GJZGRUSLSA-N	0	3	314.404	3.490	10	70		DGIEHN
Cc1ccccc1[C@H](C)N[C@H](C)C(=O)NCc1ccc(F)cc1	ZINC000159435617	432684186	/nfs/dbraw/zinc/68/41/86/432684186.db2.gz	ZEYYTAZXSKXLFF-LSDHHAIUSA-N	0	3	314.404	3.490	10	70		DGIEHN
C[C@@H](c1ccccn1)N(C)CCN(C)Cc1ccc(F)cc1	ZINC000161189890	432764667	/nfs/dbraw/zinc/76/46/67/432764667.db2.gz	VGJWSBAZMSHEFE-HNNXBMFYSA-N	0	3	301.409	3.346	10	70		DGIEHN
CCC[C@@H](C(=O)N[C@H]1CCSc2ccc(F)cc21)N(C)C	ZINC000161334896	432772470	/nfs/dbraw/zinc/77/24/70/432772470.db2.gz	DFWYLGKNSUXKQF-KBPBESRZSA-N	0	3	310.438	3.209	10	70		DGIEHN
Fc1cc(Cl)cc(CNC[C@@H]2COc3ccccc3O2)c1	ZINC000160819890	432744578	/nfs/dbraw/zinc/74/45/78/432744578.db2.gz	GCINAPPLCPDOTE-CQSZACIVSA-N	0	3	307.752	3.409	10	70		DGIEHN
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)N[C@H]1CCCOC1	ZINC000159576507	546055425	/nfs/dbraw/zinc/05/54/25/546055425.db2.gz	VPZUCXITVJPZAV-RBUKOAKNSA-N	0	3	324.424	3.005	10	70		DGIEHN
OCc1cccc(CNCc2ccc(Br)c(F)c2)c1	ZINC000217843922	165378284	/nfs/dbraw/zinc/37/82/84/165378284.db2.gz	RLPIPWOVFVTIDL-UHFFFAOYSA-N	0	3	324.193	3.370	10	70		DGIEHN
Cn1nccc1C1CCN(Cc2ccc(OC(F)F)cc2)CC1	ZINC000160527104	432724704	/nfs/dbraw/zinc/72/47/04/432724704.db2.gz	IEEXSINJGWPLSK-UHFFFAOYSA-N	0	3	321.371	3.401	10	70		DGIEHN
CCN(CCC(=O)NCC1CCCCC1)CCc1nccs1	ZINC000159424427	432682978	/nfs/dbraw/zinc/68/29/78/432682978.db2.gz	FGODNBIFXUXSKL-UHFFFAOYSA-N	0	3	323.506	3.094	10	70		DGIEHN
CCC[C@H](C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1)N(C)C	ZINC000161453698	432779645	/nfs/dbraw/zinc/77/96/45/432779645.db2.gz	JUWMGRSHBNCZRR-SMDDNHRTSA-N	0	3	314.376	3.196	10	70		DGIEHN
O[C@@]12CCCC[C@@H]1CN(CCOc1ccc(Cl)cc1)CC2	ZINC000160807264	534422405	/nfs/dbraw/zinc/42/24/05/534422405.db2.gz	FKLBTUCLTLPIBK-RHSMWYFYSA-N	0	3	309.837	3.346	10	70		DGIEHN
Cc1nc2cc(NC(=O)N(C)[C@@H]3CCN(C)[C@H](C)C3)ccc2o1	ZINC000159453630	197355227	/nfs/dbraw/zinc/35/52/27/197355227.db2.gz	ZQOXJYGJTWNFTN-BXUZGUMPSA-N	0	3	316.405	3.083	10	70		DGIEHN
Cc1ccc(C(=O)CCN2CCC(Cn3cccn3)CC2)cc1	ZINC000159441383	197354523	/nfs/dbraw/zinc/35/45/23/197354523.db2.gz	SSJKQJSDFKILAA-UHFFFAOYSA-N	0	3	311.429	3.177	10	70		DGIEHN
CC(C)[C@@H](C)N[C@H](C)C(=O)Nc1ccccc1OC(F)F	ZINC000160452378	164590516	/nfs/dbraw/zinc/59/05/16/164590516.db2.gz	NUFGCDQVYGLGGV-GHMZBOCLSA-N	0	3	300.349	3.249	10	70		DGIEHN
COC(=O)c1ccc(CN(CCc2nccs2)C(C)C)s1	ZINC000159879481	432699116	/nfs/dbraw/zinc/69/91/16/432699116.db2.gz	ZLYQSDZTGVFNOQ-UHFFFAOYSA-N	0	3	324.471	3.444	10	70		DGIEHN
C[C@@H]1CCC[C@@H](C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000161277205	432769699	/nfs/dbraw/zinc/76/96/99/432769699.db2.gz	BZDJHRSQUQYZOU-NXHRZFHOSA-N	0	3	302.462	3.102	10	70		DGIEHN
CCn1cnnc1[C@@H]1CCCN(Cc2ccccc2Cl)C1	ZINC000161338775	432772888	/nfs/dbraw/zinc/77/28/88/432772888.db2.gz	GDWHEIGLZBXMKS-CQSZACIVSA-N	0	3	304.825	3.331	10	70		DGIEHN
COc1ccc(CN2CC[C@@]3(O)CCCC[C@@H]3C2)cc1Cl	ZINC000161395250	432776753	/nfs/dbraw/zinc/77/67/53/432776753.db2.gz	RNONDLOUUVPMQJ-PBHICJAKSA-N	0	3	309.837	3.476	10	70		DGIEHN
O[C@@]12CCCC[C@@H]1CN(CCOc1cccc(Cl)c1)CC2	ZINC000160750226	534422254	/nfs/dbraw/zinc/42/22/54/534422254.db2.gz	AFIVOMRZHRKFAI-RHSMWYFYSA-N	0	3	309.837	3.346	10	70		DGIEHN
C[C@@H]1CC[C@@H](NC(=O)NC[C@@H]2CCCN2C)c2ccccc21	ZINC000159717108	432694358	/nfs/dbraw/zinc/69/43/58/432694358.db2.gz	JZXMKPDQMOQZIM-JKIFEVAISA-N	0	3	301.434	3.018	10	70		DGIEHN
CO[C@]1(CN[C@H]2CCCc3sc(Cl)cc32)CCOC1	ZINC000160099354	432706120	/nfs/dbraw/zinc/70/61/20/432706120.db2.gz	YBYZDHPMKKOBQW-FZMZJTMJSA-N	0	3	301.839	3.174	10	70		DGIEHN
CC(C)CO[C@H]1CCN(CCN(C)Cc2ccc(F)cc2)C1	ZINC000160170574	432709601	/nfs/dbraw/zinc/70/96/01/432709601.db2.gz	HQACDNVCNLYAPN-SFHVURJKSA-N	0	3	308.441	3.004	10	70		DGIEHN
C[C@@H](N[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccn1	ZINC000159366323	432682235	/nfs/dbraw/zinc/68/22/35/432682235.db2.gz	XJHGFKHKZYJZPZ-CHWSQXEVSA-N	0	3	302.809	3.060	10	70		DGIEHN
O=C1CCCN1CCCN[C@@H]1CCCOc2c(Cl)cccc21	ZINC000159491571	432685711	/nfs/dbraw/zinc/68/57/11/432685711.db2.gz	JBZSDCYQWRCHAT-OAHLLOKOSA-N	0	3	322.836	3.156	10	70		DGIEHN
C[C@@H]1CC[C@H](NC(=O)NC2CCN(C)CC2)c2ccccc21	ZINC000159569990	432688035	/nfs/dbraw/zinc/68/80/35/432688035.db2.gz	UDYQGTQOTKFQHK-DYVFJYSZSA-N	0	3	301.434	3.018	10	70		DGIEHN
Cc1ccc(-c2ccc(CN3C[C@@H](C(N)=O)CC[C@@H]3C)o2)cc1	ZINC000159661572	432691465	/nfs/dbraw/zinc/69/14/65/432691465.db2.gz	IPZOJMGUBULNRF-HOCLYGCPSA-N	0	3	312.413	3.341	10	70		DGIEHN
Cc1c2cc(C)ccc2[nH]c1C(=O)NC1CCN(C2CC2)CC1	ZINC000161246290	432768330	/nfs/dbraw/zinc/76/83/30/432768330.db2.gz	HIYOAXPKAZOQRT-UHFFFAOYSA-N	0	3	311.429	3.141	10	70		DGIEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2c(Cl)cccc2Cl)C1	ZINC000161386236	432776639	/nfs/dbraw/zinc/77/66/39/432776639.db2.gz	RXCOQBIWWCNKSK-MFKMUULPSA-N	0	3	315.244	3.452	10	70		DGIEHN
CCC[C@@H](C(=O)N(CC)Cc1ccc(Cl)s1)N(C)C	ZINC000161399360	292834443	/nfs/dbraw/zinc/83/44/43/292834443.db2.gz	ONIPFPROSJRMBU-LBPRGKRZSA-N	0	3	302.871	3.480	10	70		DGIEHN
CC(=O)CCN(CCCO)C(c1ccccc1)c1ccccc1	ZINC000160050222	197381838	/nfs/dbraw/zinc/38/18/38/197381838.db2.gz	AARZIVLPFHDKSF-UHFFFAOYSA-N	0	3	311.425	3.440	10	70		DGIEHN
CCc1cnc(CN(C)CCN(C)Cc2ccc(F)cc2)s1	ZINC000159971950	432703844	/nfs/dbraw/zinc/70/38/44/432703844.db2.gz	FIRKFGYVHLQUOD-UHFFFAOYSA-N	0	3	321.465	3.408	10	70		DGIEHN
CN(C)[C@H]1CCN(C(=O)Cc2cc3c(ccc4ccccc34)o2)C1	ZINC000160514376	432725218	/nfs/dbraw/zinc/72/52/18/432725218.db2.gz	UOMFLSRDZBYWHN-HNNXBMFYSA-N	0	3	322.408	3.291	10	70		DGIEHN
CCC[C@@H](C(=O)NCc1ccc(C(F)(F)F)cc1)N(C)C	ZINC000161341964	432774264	/nfs/dbraw/zinc/77/42/64/432774264.db2.gz	NTTJHZOCZDTTQO-ZDUSSCGKSA-N	0	3	302.340	3.052	10	70		DGIEHN
CCC[C@@H](C(=O)NCc1ccc2cc(OC)ccc2c1)N(C)C	ZINC000161355224	432774841	/nfs/dbraw/zinc/77/48/41/432774841.db2.gz	KIOBFXQFCXCELP-SFHVURJKSA-N	0	3	314.429	3.195	10	70		DGIEHN
CCC[C@@H](C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1)N(C)C	ZINC000161453569	432780337	/nfs/dbraw/zinc/78/03/37/432780337.db2.gz	JUWMGRSHBNCZRR-FZMZJTMJSA-N	0	3	314.376	3.196	10	70		DGIEHN
C[C@@H]1CCCCN1CCNC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F	ZINC000160576476	432728941	/nfs/dbraw/zinc/72/89/41/432728941.db2.gz	RNXBRAPDWCLDCQ-BPLDGKMQSA-N	0	3	322.399	3.059	10	70		DGIEHN
C/C(=C/c1ccc(Cl)cc1)CNCCNC(=O)c1ccco1	ZINC000159919248	292803667	/nfs/dbraw/zinc/80/36/67/292803667.db2.gz	YNILLCWHILAVAJ-QBFSEMIESA-N	0	3	318.804	3.356	10	70		DGIEHN
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)N[C@@H]1CCCOC1	ZINC000159576260	546054520	/nfs/dbraw/zinc/05/45/20/546054520.db2.gz	VPZUCXITVJPZAV-RTBURBONSA-N	0	3	324.424	3.005	10	70		DGIEHN
Cc1nc2cc(NC(=O)N(C)[C@H]3CCN(C)[C@H](C)C3)ccc2o1	ZINC000159453772	197355420	/nfs/dbraw/zinc/35/54/20/197355420.db2.gz	ZQOXJYGJTWNFTN-RISCZKNCSA-N	0	3	316.405	3.083	10	70		DGIEHN
C[C@@H]1CC[C@H](NC(=O)NC[C@@H]2CCCN2C)c2ccccc21	ZINC000159716858	432693186	/nfs/dbraw/zinc/69/31/86/432693186.db2.gz	JZXMKPDQMOQZIM-KEYYUXOJSA-N	0	3	301.434	3.018	10	70		DGIEHN
C[C@@H]1CC[C@H](NC(=O)NC[C@@H]2CCCN(C)C2)c2ccccc21	ZINC000159805659	432697453	/nfs/dbraw/zinc/69/74/53/432697453.db2.gz	DJGNLODHQTUKJR-VKJFTORMSA-N	0	3	315.461	3.266	10	70		DGIEHN
Cc1ccc(-c2ccc(CN3C[C@H](C(N)=O)CC[C@@H]3C)o2)cc1	ZINC000159661451	432691493	/nfs/dbraw/zinc/69/14/93/432691493.db2.gz	IPZOJMGUBULNRF-GOEBONIOSA-N	0	3	312.413	3.341	10	70		DGIEHN
CCOc1ccccc1CN1CCC[C@H](Cc2noc(C)n2)C1	ZINC000161046878	432756449	/nfs/dbraw/zinc/75/64/49/432756449.db2.gz	WCNWMUPXPGJYNA-OAHLLOKOSA-N	0	3	315.417	3.231	10	70		DGIEHN
CCC[C@H](C(=O)N(CC)Cc1ccc(Cl)s1)N(C)C	ZINC000161399476	432776994	/nfs/dbraw/zinc/77/69/94/432776994.db2.gz	ONIPFPROSJRMBU-GFCCVEGCSA-N	0	3	302.871	3.480	10	70		DGIEHN
CS[C@H](C)CC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000161414764	432777829	/nfs/dbraw/zinc/77/78/29/432777829.db2.gz	VSSWEFIAGUAUMH-WBVHZDCISA-N	0	3	320.502	3.299	10	70		DGIEHN
Cc1ccc(C(=O)CCN2CC[C@H](CNc3ccccn3)C2)cc1	ZINC000159765106	197362287	/nfs/dbraw/zinc/36/22/87/197362287.db2.gz	UKIHNUXJYNSYSD-QGZVFWFLSA-N	0	3	323.440	3.397	10	70		DGIEHN
COCCCCN1C[C@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000161072418	277204273	/nfs/dbraw/zinc/20/42/73/277204273.db2.gz	SVFUIVRONYPDLY-HUUCEWRRSA-N	0	3	317.351	3.240	10	70		DGIEHN
CC(C)COc1ccc([C@H](C)NC(=O)CN(C)C(C)C)cc1	ZINC000159766500	432695244	/nfs/dbraw/zinc/69/52/44/432695244.db2.gz	MEFRJYYSGFPZFY-HNNXBMFYSA-N	0	3	306.450	3.239	10	70		DGIEHN
COc1ccc(OCCN(CCc2nccs2)C(C)C)cc1	ZINC000159946650	432703592	/nfs/dbraw/zinc/70/35/92/432703592.db2.gz	KODGQAFECCLWHK-UHFFFAOYSA-N	0	3	320.458	3.484	10	70		DGIEHN
CCS[C@H](C(=O)NC[C@H]1CCCN1CC(C)C)C(C)C	ZINC000160523747	432725349	/nfs/dbraw/zinc/72/53/49/432725349.db2.gz	YHCREKDECVKJES-CABCVRRESA-N	0	3	300.512	3.001	10	70		DGIEHN
OCC1(NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1	ZINC000159551434	432686613	/nfs/dbraw/zinc/68/66/13/432686613.db2.gz	LPMJNVKGQHXQSD-UHFFFAOYSA-N	0	3	313.241	3.339	10	70		DGIEHN
C[C@H]1CC[C@H](NC(=O)NC2CCN(C)CC2)c2ccccc21	ZINC000159570135	432688930	/nfs/dbraw/zinc/68/89/30/432688930.db2.gz	UDYQGTQOTKFQHK-GUYCJALGSA-N	0	3	301.434	3.018	10	70		DGIEHN
CCN(CCc1nccs1)CCN(C)Cc1ccc(F)cc1	ZINC000161019055	432754365	/nfs/dbraw/zinc/75/43/65/432754365.db2.gz	QZPGWCPCRXPVQF-UHFFFAOYSA-N	0	3	321.465	3.279	10	70		DGIEHN
C[C@@H]1CCC[C@@H](OCCCCCC(=O)N2CC[C@H](N(C)C)C2)C1	ZINC000161373438	432776916	/nfs/dbraw/zinc/77/69/16/432776916.db2.gz	VVLQRIUMDYFUQJ-FGTMMUONSA-N	0	3	324.509	3.305	10	70		DGIEHN
CS[C@@H](C)CC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000161414653	432778544	/nfs/dbraw/zinc/77/85/44/432778544.db2.gz	VSSWEFIAGUAUMH-RDJZCZTQSA-N	0	3	320.502	3.299	10	70		DGIEHN
CCC[C@H](C(=O)NCc1ccc2cc(OC)ccc2c1)N(C)C	ZINC000161355320	292834033	/nfs/dbraw/zinc/83/40/33/292834033.db2.gz	KIOBFXQFCXCELP-GOSISDBHSA-N	0	3	314.429	3.195	10	70		DGIEHN
CC[C@H](C(=O)N1CCC[C@@H](c2nc(C(C)C)cs2)C1)N(C)C	ZINC000160477833	523760013	/nfs/dbraw/zinc/76/00/13/523760013.db2.gz	KHUTUCARKAHKNJ-UKRRQHHQSA-N	0	3	323.506	3.313	10	70		DGIEHN
COC[C@@H]1CCCN(C[C@@H]2CC(c3ccc(Cl)cc3)=NO2)C1	ZINC000159821823	197367374	/nfs/dbraw/zinc/36/73/74/197367374.db2.gz	NNFCTRONTYOIRB-CJNGLKHVSA-N	0	3	322.836	3.191	10	70		DGIEHN
CC[C@H](C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C)c1ccc(F)cc1	ZINC000161020388	432754650	/nfs/dbraw/zinc/75/46/50/432754650.db2.gz	BGRMQIIZSQVZRF-JQFCIGGWSA-N	0	3	306.425	3.164	10	70		DGIEHN
CCC[C@H](C(=O)NCCCO[C@@H](C)c1ccccc1)N(C)C	ZINC000161308871	432771491	/nfs/dbraw/zinc/77/14/91/432771491.db2.gz	HDYLCHDSSKOQQV-DOTOQJQBSA-N	0	3	306.450	3.001	10	70		DGIEHN
CC(C)N1C[C@H](NC(=O)c2c(Cl)cccc2Cl)[C@@H](C)C1	ZINC000161386355	432776841	/nfs/dbraw/zinc/77/68/41/432776841.db2.gz	RXCOQBIWWCNKSK-GWCFXTLKSA-N	0	3	315.244	3.452	10	70		DGIEHN
C/C(=C\c1ccc(Cl)cc1)CNC[C@H](O)COCC(C)C	ZINC000160117795	292807536	/nfs/dbraw/zinc/80/75/36/292807536.db2.gz	LQTLCESPXILLSX-AAKUMTKESA-N	0	3	311.853	3.366	10	70		DGIEHN
CC[C@](C)(O)CN(C)Cc1c(C)nn(-c2ccccc2C)c1C	ZINC000160680165	529372813	/nfs/dbraw/zinc/37/28/13/529372813.db2.gz	GRGJFYAMZCJSNY-IBGZPJMESA-N	0	3	315.461	3.390	10	70		DGIEHN
Cc1ccc(CNc2ccc(OC3CCN(C)CC3)nc2)o1	ZINC000160166469	432708682	/nfs/dbraw/zinc/70/86/82/432708682.db2.gz	VKCPPTBCCAWGMV-UHFFFAOYSA-N	0	3	301.390	3.068	10	70		DGIEHN
CC[C@H](C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)c1ccc(F)cc1	ZINC000160420851	432719754	/nfs/dbraw/zinc/71/97/54/432719754.db2.gz	KBXQVIFBEATCBL-COXVUDFISA-N	0	3	306.425	3.260	10	70		DGIEHN
CCC[C@@H](C(=O)NCCCO[C@H](C)c1ccccc1)N(C)C	ZINC000161308969	432771105	/nfs/dbraw/zinc/77/11/05/432771105.db2.gz	HDYLCHDSSKOQQV-WBVHZDCISA-N	0	3	306.450	3.001	10	70		DGIEHN
CCC[C@@H](C(=O)NCCCO[C@@H](C)c1ccccc1)N(C)C	ZINC000161308749	432771441	/nfs/dbraw/zinc/77/14/41/432771441.db2.gz	HDYLCHDSSKOQQV-RDJZCZTQSA-N	0	3	306.450	3.001	10	70		DGIEHN
O[C@H](CN1CC[C@]2(O)CCCC[C@@H]2C1)c1cccc(Cl)c1	ZINC000160810888	432742998	/nfs/dbraw/zinc/74/29/98/432742998.db2.gz	OBQWCHHLVZLJAI-DJIMGWMZSA-N	0	3	309.837	3.000	10	70		DGIEHN
COc1cc(C(=O)N[C@@H](CC(C)C)CN(C)C)ccc1Cl	ZINC000160244802	292810699	/nfs/dbraw/zinc/81/06/99/292810699.db2.gz	AWGOPRULKNRFGW-ZDUSSCGKSA-N	0	3	312.841	3.055	10	70		DGIEHN
CCSCCN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000159657108	521706530	/nfs/dbraw/zinc/70/65/30/521706530.db2.gz	DZIZJKXRPSIHFD-UHFFFAOYSA-N	0	3	318.486	3.041	10	70		DGIEHN
CN(Cc1ccc(Br)c(F)c1)C[C@@H]1CCC[C@@H]1O	ZINC000159770361	432696399	/nfs/dbraw/zinc/69/63/99/432696399.db2.gz	DHANBDFCZPINQH-FZMZJTMJSA-N	0	3	316.214	3.181	10	70		DGIEHN
CCc1oc(C(=O)N[C@@H](CN(C)C)c2ccccc2)cc1C	ZINC000159842692	432697735	/nfs/dbraw/zinc/69/77/35/432697735.db2.gz	KHIPLTOFBVZJBB-HNNXBMFYSA-N	0	3	300.402	3.183	10	70		DGIEHN
CCC[C@H](C(=O)N1CC=C(c2ccccc2F)CC1)N(C)C	ZINC000159621942	432689838	/nfs/dbraw/zinc/68/98/38/432689838.db2.gz	BEBIRGYQQAZBNG-QGZVFWFLSA-N	0	3	304.409	3.172	10	70		DGIEHN
CN(CCN1CCC[C@@H]1c1ccncc1)Cc1ccc(F)cc1	ZINC000161166073	432763590	/nfs/dbraw/zinc/76/35/90/432763590.db2.gz	NZULIKZKPQAPEI-LJQANCHMSA-N	0	3	313.420	3.490	10	70		DGIEHN
C[C@H](NC[C@@H]1CCCC[C@@H]1O)c1cnn(Cc2ccccc2)c1	ZINC000160601021	432730703	/nfs/dbraw/zinc/73/07/03/432730703.db2.gz	PABYKGWXLXLMAB-IEZWGBDMSA-N	0	3	313.445	3.133	10	70		DGIEHN
CCCN(C(=O)c1cccs1)C1CCN(CCC(C)=O)CC1	ZINC000159743436	432693326	/nfs/dbraw/zinc/69/33/26/432693326.db2.gz	PGZRXZBMOAFTNZ-UHFFFAOYSA-N	0	3	322.474	3.044	10	70		DGIEHN
CN(CCN1CCCC[C@@H]1c1cn[nH]c1)Cc1ccc(F)cc1	ZINC000160566979	432728892	/nfs/dbraw/zinc/72/88/92/432728892.db2.gz	IIHAWBGTYWWENT-GOSISDBHSA-N	0	3	316.424	3.208	10	70		DGIEHN
CSc1ccc(OCCN2CC[C@]3(O)CCCC[C@@H]3C2)cc1	ZINC000160710912	432737242	/nfs/dbraw/zinc/73/72/42/432737242.db2.gz	TVHVTTCQHHRATG-CRAIPNDOSA-N	0	3	321.486	3.414	10	70		DGIEHN
Cc1cc(F)c(C(=O)N[C@@H](CN(C)C)c2ccccc2)cc1F	ZINC000160203740	546059492	/nfs/dbraw/zinc/05/94/92/546059492.db2.gz	MZBJSVMGLORUSH-KRWDZBQOSA-N	0	3	318.367	3.306	10	70		DGIEHN